In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2010 | 18 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.26 | 1.77 | -39.66 | 0 | 7 | -1 | 80 | 249.25 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.26 | 1.91 | -12.27 | 1 | 7 | 0 | 82 | 250.258 | 6 | ↓ |